LAMMPS (27 Nov 2018)
  using 1 OpenMP thread(s) per MPI task
units real
boundary p p p

atom_style full
bond_style harmonic
angle_style harmonic
special_bonds lj/coul 0.0 0.0 0.5

pair_style lj/cut/coul/long 12.0 12.0
kspace_style pppm 1.0e-3

read_data data.swm4-ndp
  orthogonal box = (-12 -12 -12) to (12 12 12)
  1 by 1 by 1 MPI processor grid
  reading atoms ...
  2500 atoms
  scanning bonds ...
  1 = max bonds/atom
  scanning angles ...
  1 = max angles/atom
  reading bonds ...
  2000 bonds
  reading angles ...
  500 angles
  4 = max # of 1-2 neighbors
  3 = max # of 1-3 neighbors
  3 = max # of 1-4 neighbors
  4 = max # of special neighbors

pair_coeff    1    1      0.210939     3.183950  # ODw ODw
pair_coeff    *   2*      0.000000     0.0

group ATOMS type 1:3
2000 atoms in group ATOMS
group CORES type 1
500 atoms in group CORES
group DRUDES type 4
500 atoms in group DRUDES

variable TK equal 300.0
variable TDK equal 1.0
variable PBAR equal 1.0

neighbor 2.0 bin

timestep 1.0

fix DRUDE all drude C N N D

velocity ATOMS create ${TK} 12345
velocity ATOMS create 300 12345
velocity DRUDES create ${TDK} 12345
velocity DRUDES create 1 12345

delete_bonds ATOMS multi
PPPM initialization ...
  using 12-bit tables for long-range coulomb (src/kspace.cpp:321)
  G vector (1/distance) = 0.217457
  grid = 10 10 10
  stencil order = 5
  estimated absolute RMS force accuracy = 0.197288
  estimated relative force accuracy = 0.000594128
  using double precision FFTs
  3d grid and FFT values/proc = 3375 1000
Rebuild special list taking Drude particles into account
Old max number of 1-2 to 1-4 neighbors: 4
New max number of 1-2 to 1-4 neighbors: 4 (+0)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 14
  ghost atom cutoff = 14
  binsize = 7, bins = 4 4 4
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair lj/cut/coul/long, perpetual
      attributes: half, newton on
      pair build: half/bin/newton
      stencil: half/bin/3d/newton
      bin: standard
  2000 total bonds, 500 turned on, 1500 turned off
  500 total angles, 0 turned on, 500 turned off
  0 total dihedrals, 0 turned on, 0 turned off
  0 total impropers, 0 turned on, 0 turned off

comm_modify vel yes
compute TATOM ATOMS temp/com
compute TEMP all temp/drude

fix DTDIR all drude/transform/direct
fix RIGID ATOMS rigid/npt/small molecule temp ${TK} ${TK} 100 iso ${PBAR} ${PBAR} 500
fix RIGID ATOMS rigid/npt/small molecule temp 300 ${TK} 100 iso ${PBAR} ${PBAR} 500
fix RIGID ATOMS rigid/npt/small molecule temp 300 300 100 iso ${PBAR} ${PBAR} 500
fix RIGID ATOMS rigid/npt/small molecule temp 300 300 100 iso 1 ${PBAR} 500
fix RIGID ATOMS rigid/npt/small molecule temp 300 300 100 iso 1 1 500
500 rigid bodies with 2000 atoms
  0.832099 = max distance from body owner to body atom
fix_modify RIGID temp TATOM press thermo_press
WARNING: Temperature for fix modify is not for group all (src/RIGID/fix_rigid_nh_small.cpp:1338)
fix NVT DRUDES nvt temp ${TDK} ${TDK} 100.0
fix NVT DRUDES nvt temp 1 ${TDK} 100.0
fix NVT DRUDES nvt temp 1 1 100.0
fix DTINV all drude/transform/inverse

thermo_style custom step cpu etotal ke pe ebond eangle evdwl ecoul elong press vol temp c_TEMP[1] c_TEMP[2]
thermo 20

run 2000
PPPM initialization ...
  using 12-bit tables for long-range coulomb (src/kspace.cpp:321)
  G vector (1/distance) = 0.217457
  grid = 10 10 10
  stencil order = 5
  estimated absolute RMS force accuracy = 0.197288
  estimated relative force accuracy = 0.000594128
  using double precision FFTs
  3d grid and FFT values/proc = 3375 1000
Per MPI rank memory allocation (min/avg/max) = 36.15 | 36.15 | 36.15 Mbytes
Step CPU TotEng KinEng PotEng E_bond E_angle E_vdwl E_coul E_long Press Volume Temp c_TEMP[1] c_TEMP[2] 
       0            0    4568.0415    903.41148      3664.63    623.46454            0    2890.2449    157955.66   -157804.74    244591.08        13824    202.18534    295.64644    14.858785 
      20    1.3635511    3742.6843    5338.7884   -1596.1041    567.30749            0    662.23765    155098.37   -157924.01    31679.425    13979.574    1194.8318    1690.2246    201.65659 
      40    2.8319206    2752.8326    4407.7651   -1654.9326    793.00136            0     870.3308    154593.76   -157912.03    27394.569     14278.56    986.46689    1450.7477    55.932383 
      60    4.2769592    1995.5898     3982.037   -1986.4472    660.67727            0    750.60931    154536.67    -157934.4    22230.525    14691.401    891.18805    1315.7323    40.317105 
      80    5.6864653    1376.4611    3451.5427   -2075.0816      617.739            0    606.36728    154625.69   -157924.88    17342.361    15201.343    772.46234    1147.1933    21.455572 
     100    7.0593393    885.62035    3037.6307   -2152.0103    536.23281            0    448.92338    154793.05   -157930.22    13263.277    15783.251    679.82798    1011.6853    14.753602 
     120    8.3966329    487.59021    2926.9825   -2439.3923    534.45241            0    332.92674    154624.58   -157931.35    8680.1218    16409.225    655.06468    977.01117    9.8615821 
     140    9.6922171    159.94255    2531.0921   -2371.1495    507.26507            0    248.61566    154802.72   -157929.75    6400.0155    17052.819     566.4636    845.55884     7.140197 
     160    10.950651   -100.91956    2408.1664   -2509.0859    490.99483            0    134.36058     154800.6   -157935.04    3836.9925    17698.151    538.95257     805.1915    5.3968131 
     180    12.172047   -313.40678    2221.7371   -2535.1439    469.97826            0    75.806422    154853.24   -157934.17    1959.0003    18334.826    497.22932    743.13919    4.4151403 
     200    13.369177   -490.93825    2067.2564   -2558.1946    455.16083            0    77.543554    154841.16   -157932.06    1193.4025    18956.449    462.65622    691.72198    3.5993868 
     220    14.438093   -642.88359    1962.7222   -2605.6058    481.40176            0    64.823738    154779.31   -157931.14    258.47931    19559.018    439.26127    657.06568    2.7739198 
     240    15.577558   -770.43472    1795.7362   -2566.1709    467.25739            0    68.825446    154830.01   -157932.26    19.605411    20139.418    401.88945    601.23804    2.3884997 
     260    16.688265   -878.62151    1752.9509   -2631.5724    476.39236            0    71.926651    154747.16   -157927.05   -779.07206    20696.166    392.31402    587.06568    2.0260792 
     280    17.682964   -971.81622    1649.6272   -2621.4434    473.84812            0    58.450385    154779.58   -157933.32   -1008.5258    21226.441    369.18995    552.55677    1.7179235 
     300    18.755012   -1057.4737    1581.0153   -2638.4889    480.33302            0    92.047223    154721.85   -157932.72   -1272.4892    21728.979    353.83447    529.64527    1.5051853 
     320    19.774572   -1132.8157    1506.8725   -2639.6882    477.53234            0    107.39639    154707.65   -157932.27   -1097.9626    22203.697    337.24116    504.84512    1.3587573 
     340     20.69206    -1199.489    1494.9584   -2694.4474    479.87519            0    106.49874    154656.38    -157937.2   -1428.8049    22652.416    334.57476    500.90442    1.2462835 
     360    21.652272   -1264.9018    1440.9759   -2705.8778    491.74088            0    107.21802    154624.72   -157929.55   -1585.5815    23073.033    322.49337    482.81675    1.2016239 
     380    22.541014   -1323.4812    1376.8139    -2700.295    497.62389            0    130.73162    154602.95    -157931.6   -1822.4176     23465.34    308.13377    461.36583    1.0533711 
     400    23.429899   -1373.4313    1375.7746   -2749.2059     504.5216            0    124.40122    154554.57    -157932.7   -2024.2519    23828.151    307.90118    461.05182   0.98409512 
     420     24.30185   -1426.2004    1375.0825   -2801.2829     515.4234            0    141.95789    154473.92   -157932.58   -2211.7434    24159.844    307.74628    460.87881   0.86572884 
     440    25.220268   -1475.8906    1324.8476   -2800.7382    535.08125            0    196.94504     154398.6   -157931.36   -1603.3424    24460.372    296.50361    443.98822   0.94139759 
     460    26.069995   -1526.8146    1312.6512   -2839.4658    567.30401            0    263.15706    154263.01   -157932.94    -1446.573    24734.601    293.77403    439.95008   0.83440493 
     480    26.912804   -1575.0902    1310.7022   -2885.7924    595.89933            0    312.71625    154137.37   -157931.78   -1115.9617    24986.067    293.33784    439.29118   0.84448526 
     500    27.750046    -1625.867    1316.9545   -2942.8215    622.71944            0    334.05272    154029.75   -157929.34   -1178.3349    25218.467    294.73713    441.38984   0.84223525 
     520    28.580007   -1677.8147    1275.1901   -2953.0048    636.81498            0    364.43482    153975.25   -157929.51   -1185.7191    25432.383    285.39015    427.42176   0.75616765 
     540    29.461706   -1724.6335    1253.4762   -2978.1096    632.62875            0     336.7701    153984.65   -157932.16    -1475.652    25627.637    280.53054    420.14989   0.73078744 
     560    30.284055   -1768.8039    1262.2867   -3031.0907    642.26972            0    309.98943    153946.77   -157930.12   -1811.8157    25800.729    282.50237    423.09732   0.74744177 
     580    31.099254   -1811.2401    1227.9083   -3039.1484    678.22201            0    368.41929    153846.44   -157932.23   -1409.4088    25948.882    274.80841    411.53414   0.80732891 
     600    31.912324   -1853.2774    1206.9943   -3060.2717    700.63403            0    436.68693    153737.89   -157935.48   -992.41608    26077.285    270.12781     404.5385   0.76616257 
     620    32.720867    -1895.189    1204.3588   -3099.5478    691.72649            0    400.33253    153741.91   -157933.52   -1388.6703    26189.589    269.53797    403.65884   0.75715127 
     640    33.582986   -1935.0173    1187.9183   -3122.9356    705.21393            0    424.23263    153679.52    -157931.9   -1350.2348    26282.622    265.85856    398.13366   0.77665339 
     660    34.390937   -1971.7086    1162.7479   -3134.4565    702.26031            0    428.42789    153668.92   -157934.06   -1188.7971    26357.244    260.22536    389.70613   0.74337722 
     680    35.194277   -2009.3204    1181.9615    -3191.282    730.54911            0    440.01944    153571.31   -157933.16   -1362.8153    26413.989    264.52542    396.12452   0.79816042 
     700    35.997317   -2050.9709    1191.8391   -3242.8101    753.00327            0     467.6939    153468.36   -157931.87   -1482.0887    26451.007    266.73604    399.41272   0.84921753 
     720    36.797657   -2089.4271    1150.0076   -3239.4347    754.31976            0    503.35736    153436.75   -157933.87    -1244.458    26468.888    257.37407    385.38778   0.83191363 
     740    37.600469   -2125.3798    1154.3541   -3279.7339    774.13557            0    529.42004    153350.85   -157934.14   -1118.7575    26470.499    258.34683    386.83315   0.85749243 
     760    38.401939   -2161.7135    1130.3511   -3292.0647    796.77441            0    536.43801    153307.45   -157932.73   -1175.0129    26456.703     252.9749    378.79415   0.83045948 
     780    39.260591   -2198.2814    1150.3816   -3348.6631    831.65486            0    563.13944    153188.89   -157932.35    -1176.261    26427.139    257.45777    385.51594   0.82651674 
     800    40.064371   -2234.1521    1110.6647   -3344.8168    855.23508            0    601.01417    153131.92   -157932.98   -862.30786    26382.746    248.56904    372.17004   0.86990233 
     820    40.870016   -2267.8439    1102.4715   -3370.3153    860.65298            0    594.70187    153108.56   -157934.23   -1010.8125    26326.235    246.73537    369.40044   0.91177598 
     840    41.681368   -2299.1566    1078.3708   -3377.5273    859.59901            0    593.35932    153101.25   -157931.73   -865.53535    26257.386    241.34159    361.33643   0.86924241 
     860    42.495518   -2331.8875     1107.384   -3439.2715    881.30207            0    614.64915    152998.03   -157933.26   -1071.9258     26177.36    247.83481    371.04249   0.92379597 
     880     43.30765   -2362.8811    1111.5783   -3474.4594    878.94272            0    592.04533    152990.05    -157935.5   -1381.2745    26084.115    248.77351    372.40018    1.0226212 
     900    44.121972   -2394.8169     1068.126   -3462.9429    875.67985            0    600.20259    152996.32   -157935.15   -1082.6484    25975.468     239.0488    357.84385   0.98060155 
     920    44.942671   -2427.7497    1051.3836   -3479.1333    900.00235            0    630.10877    152926.67   -157935.91   -1219.7107    25853.048    235.30182    352.19248     1.049881 
     940    45.823624    -2454.734    1033.0018   -3487.7359    898.98611            0    622.98212    152924.56   -157934.26   -1017.3685    25716.622    231.18793    346.03843    1.0245683 
     960    46.651637   -2482.3376    1051.4989   -3533.8365    882.79039            0     607.4772    152907.91   -157932.02   -1287.7224    25567.669    235.32761    352.20104    1.1100984 
     980    47.483709   -2510.9021    1063.1436   -3574.0457    917.45654            0    628.78148    152815.06   -157935.34   -1318.0782    25404.812    237.93373    356.07751    1.1703057 
    1000      48.3218   -2539.3123    1076.5262   -3615.8385    929.24497            0     620.5376    152770.95   -157936.57   -1437.1421     25228.96    240.92878     360.5539    1.1966823 
    1020    49.120018   -2568.5635    1047.1393   -3615.7027    927.28535            0    622.11842     152769.9      -157935   -1455.4685    25039.532    234.35192    350.71529    1.1564745 
    1040     49.90245   -2600.2331    1062.6806   -3662.9136    955.48542            0    644.04662    152672.56   -157935.01   -1384.5306    24836.175    237.83009    355.87178    1.2710552 
    1060     50.69897   -2630.1462    1061.5152   -3691.6614    986.58819            0    682.07977    152579.13   -157939.46   -1344.1472    24620.038    237.56929     355.4358    1.3611209 
    1080    51.503865   -2659.3124    1028.5625   -3687.8749    1013.1448            0    748.60853    152486.11   -157935.74   -632.77731    24393.781     230.1944     344.4159    1.2910154 
    1100    52.317019   -2686.7631    1046.6402   -3733.4033    1010.8277            0    734.27617    152460.31   -157938.82   -853.90087    24163.398    234.24022    350.47672    1.2987412 
    1120    53.191877   -2717.3602    1100.2788    -3817.639    1053.1519            0    729.94563     152339.1   -157939.84   -1341.3046    23928.078    246.24466    368.47141    1.2986799 
    1140    54.021756   -2749.0229    1075.5657   -3824.5886    1053.2247            0     772.2959    152288.35   -157938.46    -589.3316    23686.107    240.71381    360.21003    1.2399432 
    1160    54.861993   -2781.7214    1067.9567   -3849.6781    1074.5488            0    806.08569    152208.08   -157938.39   -831.19568    23442.775     239.0109     357.6544    1.2458686 
    1180    55.710942    -2810.148    1089.8079   -3899.9559    1109.6809            0    845.87985    152083.25   -157938.76   -222.17835    23198.413    243.90125    365.01942    1.1770946 
    1200     56.57052   -2842.1991     1074.027   -3916.2261    1125.4801            0     878.8665    152014.69   -157935.26   -448.25353    22957.682    240.36945     359.7275    1.1726032 
    1220    57.436566   -2870.9683    1065.5007    -3936.469    1121.3024            0    895.48147    151984.11   -157937.36    -49.04933    22721.016    238.46125    356.86483    1.1771853 
    1240     58.31029   -2898.6134    1082.9239   -3981.5374    1156.8878            0    872.68215    151926.15   -157937.26   -519.72203      22490.6     242.3606    362.72866     1.139753 
    1260    59.192157   -2928.7913    1040.5848   -3969.3761    1145.0651            0    909.81511    151912.71   -157936.97   -29.590267    22264.147    232.88502    348.55509    1.0791106 
    1280    60.142411   -2955.6846    1022.8912   -3978.5758     1140.672            0    883.63602    151933.74   -157936.62   -175.91605    22043.467    228.92516    342.58962    1.1383994 
    1300     61.07528   -2981.9373    1075.9497    -4057.887    1158.7075            0    849.86519    151871.92   -157938.38    -934.6555     21827.24    240.79975    360.40764    1.1023778 
    1320    62.024172   -3008.7547    1034.6665   -4043.4212    1150.8314            0    884.82764    151858.67   -157937.75   -365.70526    21611.763    231.56049    346.60301    1.0123134 
    1340    62.982555   -3034.4981    1059.0543   -4093.5524    1167.4937            0    873.78686     151802.9   -157937.73   -607.20768    21399.603    237.01853    354.83546   0.91062335 
    1360    63.941291   -3061.6404     1086.842   -4148.4824    1203.2944            0    877.27308    151711.62   -157940.67   -877.19102    21189.111    243.23747    364.15541   0.91512372 
    1380     64.90951   -3092.7485    1046.5902   -4139.3388    1239.0597            0    915.00432     151646.1   -157939.51   -519.03533    20978.348    234.22904    350.66459    0.8894947 
    1400    65.889121    -3121.488    1051.0689   -4172.5569    1298.7247            0    989.25234    151480.54   -157941.07   -54.596483    20769.447    235.23138    352.15827   0.90714599 
    1420    66.880954   -3149.3299    1046.1867   -4195.5166    1316.5513            0    1013.5453    151416.57   -157942.18   -12.199056    20566.196    234.13872    350.49775   0.95239313 
    1440    67.876446   -3172.8201    1046.5913   -4219.4114    1319.1146            0    989.68846    151410.33   -157938.54   -145.84664    20369.571    234.22928    350.68677   0.84585946 
    1460     68.88107   -3200.8425    1052.2514   -4253.0939    1296.3997            0    914.27128    151478.83   -157942.59   -1047.6067    20177.139    235.49603    352.58952   0.83805114 
    1480    69.894247   -3229.1329     1032.538   -4261.6708    1273.6899            0    884.58641    151521.54   -157941.48   -877.62887    19983.452    231.08411    345.95296   0.88426485 
    1500    71.009717   -3256.5597     1060.231   -4316.7907    1291.1374            0    874.13592    151461.84   -157943.91   -1479.1729    19788.536    237.28186    355.23846   0.89410552 
    1520    72.041054   -3283.4789    1004.9547   -4288.4336    1248.3551            0    849.40507    151555.63   -157941.83    -1210.342    19590.335    224.91093    336.73148   0.81999833 
    1540    73.084395   -3307.2541     1008.328   -4315.5821    1259.4211            0     846.2933    151520.12   -157941.42   -1328.6534    19389.457    225.66587    337.86416   0.81796565 
    1560    74.135646   -3333.4164    1009.8078   -4343.2242    1290.3482            0    843.72954     151464.8    -157942.1   -1492.5376    19185.011    225.99706    338.35783   0.82352496 
    1580    75.198241   -3359.5746    1031.9507   -4391.5253     1301.979            0    907.32598    151341.72   -157942.55   -931.21229    18977.005    230.95268    345.78871   0.81873619 
    1600    76.272058   -3383.7255    977.90216   -4361.6277    1350.9107            0    1005.0889    151225.61   -157943.23   -265.11417    18769.775    218.85651    327.62822   0.87537743 
    1620    77.356282   -3399.3062    994.75129   -4394.0575    1387.4383            0    1059.1407     151101.4   -157942.03    574.54697    18568.615    222.62738    333.25885   0.91918263 
    1640    78.448545   -3415.8361     1023.468    -4439.304    1398.4672            0     1052.931    151054.15   -157944.85    470.27927    18377.301    229.05423     342.8805   0.94357863 
    1660    79.550247    -3434.561    975.54176   -4410.1027    1429.1617            0     1081.052     151023.2   -157943.52    1049.9178    18195.592    218.32825     326.8381   0.87189374 
    1680    80.667191   -3451.4085    987.31735   -4438.7259    1473.5691            0    1116.4474    150914.31   -157943.05    1058.2306    18025.735    220.96365    330.80265   0.84371639 
    1700    81.797154    -3467.686    964.72099    -4432.407    1455.6679            0    1109.6516       150945   -157942.73    1282.6999    17867.835    215.90654    323.18716   0.91347876 
    1720    82.926758   -3484.8522    984.05698   -4468.9092    1459.9348            0    1102.3739    150911.78      -157943    919.74849    17722.037    220.23397     329.6527   0.95604421 
    1740    84.064705   -3497.8606    976.97179   -4474.8324    1401.3809            0    1034.3626    151032.67   -157943.25    535.35483    17586.464    218.64829    327.27748   0.95261024 
    1760     85.25497   -3516.3474    990.65511   -4507.0025    1393.0104            0    1015.5429    151026.85    -157942.4   -45.078457    17457.877    221.71065    331.88315   0.92222263 
    1780    86.432811   -3532.5203    981.67325   -4514.1936    1381.8497            0    1018.8916    151028.12   -157943.05    419.25311    17333.542    219.70049    328.86023   0.94159899 
    1800    87.629265   -3551.0627    978.09831    -4529.161    1409.4225            0    1023.8144    150980.45   -157942.84   -136.21958    17214.117    218.90041    327.67684   0.90973891 
    1820    88.810324    -3566.367    953.86873   -4520.2357     1386.004            0    1027.6913    151009.66   -157943.59    272.29498    17097.552    213.47778    319.53574   0.93491142 
    1840    89.996806   -3581.9401    989.35892    -4571.299    1438.2511            0    1011.4985    150924.05    -157945.1   -277.89182    16984.647    221.42056    331.39393    1.0309706 
    1860    91.192728   -3597.0855    939.72505   -4536.8105    1424.7503            0    1045.0751     150938.2   -157944.83     769.1418    16874.282    210.31239    314.73818    1.0402053 
    1880    92.395072   -3609.1452    988.80243   -4597.9477    1452.2757            0    1054.8324    150839.43   -157944.48    448.42199    16769.952    221.29601    331.17499     1.095477 
    1900    93.599308   -3623.9274    981.88757    -4605.815    1467.8981            0    1058.3428    150811.66   -157943.72    440.93441    16671.114    219.74845    328.86095    1.0839713 
    1920    94.800441   -3637.4995    962.46738   -4599.9668    1472.6584            0    1100.9414    150770.55   -157944.12    927.11674    16577.506    215.40217    322.39885   0.97801499 
    1940    96.006696   -3649.8745    932.46317   -4582.3377    1482.9302            0    1127.1576    150751.01   -157943.44     1275.661    16490.871    208.68717    312.30264    1.0388692 
    1960    97.217233   -3660.5717     957.9057   -4618.4774    1471.5387            0    1090.5959    150763.08   -157943.69    926.00133    16412.162    214.38126    320.81698     1.081062 
    1980    98.432616    -3673.974    955.97217   -4629.9462    1448.9016            0    1043.2494    150823.46   -157945.55     585.7993    16339.534    213.94853    320.15896    1.0997884 
    2000    99.651307   -3687.9477    943.17863   -4631.1263    1431.8862            0    1028.9334     150853.1   -157945.05    406.94681    16271.378    211.08531    315.85857    1.1166274 
Loop time of 99.6513 on 1 procs for 2000 steps with 2500 atoms

Performance: 1.734 ns/day, 13.840 hours/ns, 20.070 timesteps/s
98.9% CPU use with 1 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 78.424     | 78.424     | 78.424     |   0.0 | 78.70
Bond    | 0.032606   | 0.032606   | 0.032606   |   0.0 |  0.03
Kspace  | 3.7865     | 3.7865     | 3.7865     |   0.0 |  3.80
Neigh   | 9.511      | 9.511      | 9.511      |   0.0 |  9.54
Comm    | 0.71185    | 0.71185    | 0.71185    |   0.0 |  0.71
Output  | 0.0071998  | 0.0071998  | 0.0071998  |   0.0 |  0.01
Modify  | 7.1361     | 7.1361     | 7.1361     |   0.0 |  7.16
Other   |            | 0.04205    |            |       |  0.04

Nlocal:    2500 ave 2500 max 2500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    20897 ave 20897 max 20897 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    2.20428e+06 ave 2.20428e+06 max 2.20428e+06 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2204275
Ave neighs/atom = 881.71
Ave special neighs/atom = 4
Neighbor list builds = 122
Dangerous builds = 16

Total wall time: 0:01:39
